Geometry & MOs

Info

ID:	441877
PubChem CID:	135246319
Reduced:	SO6C23H30 (1)
Stoich.:	AB6C23D30 (1)
Weight, g/mol:	335.220892
ΔH_f, kcal/mol:	-217.6
Dipole, Da:	3.28
IP(EA), eV:	-9.44(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-1-[(2R,3R,5R)-3-(methylamino)-5-(2-methylbut-3-enyl)-5-propan-2-yloxolan-2-yl]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CS(=O)(=O)OCCC[C@]1([C@H](CCO1)OCC2=CC=CC=C2)COCC3=CC=CC=C3

DOS

IR

Vibrations